6-nitro-1-[(1H-1,2,4-triazol-5-ylamino)methylidene]naphthalen-2-one

Systemtic Name: 6-nitro-1-[(1H-1,2,4-triazol-5-ylamino)methylidene]naphthalen-2-one Openeye Name: 6-nitro-1-[(1H-1,2,4-triazol-5-ylamino)methylene]naphthalen-2-one CAS Name: 6-nitro-1-[(1H-1,2,4-triazol-5-ylamino)methylidene]-2-naphthalenone IUPAC Name: 6-nitro-1-[(1H-1,2,4-triazol-5-ylamino)methylidene]naphthalen-2-one Traditional Name: 6-nitro-1-[(1H-1,2,4-triazol-5-ylamino)methylene]naphthalen-2-one Formula: C13H9N5O3 MolecularWeight: 283.24226

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=O)C2=CNC3=NC=NN3)C=C1[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=CC(=O)C2=CNC3=NC=NN3)C=C1[N+](=O)[O-]

InChI

InChI=1S/C13H9N5O3/c19-12-4-1-8-5-9(18(20)21)2-3-10(8)11(12)6-14-13-15-7-16-17-13/h1-7H,(H2,14,15,16,17)